SCHEMBL8515205

SCHEMBL8515205

Cc1c(-c2ccc(Oc3ccc(Cl)cc3)cc2)[nH]c2ccccc2c1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.52
CCNB2 O95067 1/20 0.49
CDK1 P06493 1/20 0.49
CCNB1 P14635 1/20 0.49
CCNB3 Q8WWL7 1/20 0.49
KMT2A Q03164 2/20 0.46
MAPT P10636 2/20 0.46
LMNA P02545 2/20 0.46
MEN1 O00255 1/20 0.46
PTGS2 P35354 2/20 0.46
KDM4E B2RXH2 3/20 0.46
PDE10A Q9Y233 1/20 0.46
SERPINE1 P05121 1/20 0.43
MAPK13 O15264 1/20 0.43
GCGR P47871 1/20 0.43
MAPK12 P53778 1/20 0.43
MAPK11 Q15759 1/20 0.43
MAPK14 Q16539 1/20 0.43
ABCG2 Q9UNQ0 1/20 0.43
KIF11 P52732 2/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29505903 0.83 MAT2A (0.54) KMT2AMAPTLMNAKDM4EPDE10A
SCHEMBL8533470 0.83 MAT2A (0.54) KMT2AMAPTLMNAKDM4EPDE10A
SCHEMBL10067341 0.79 CCNB2 (0.63) CCNB2CDK1CCNB1CCNB3KMT2A
SCHEMBL8537070 0.78 MAT2A (0.57) SLC2A1KMT2ALMNAMEN1PTGS2
SCHEMBL8515371 0.77 MAT2A (0.56) KMT2AMAPTLMNAKDM4EPDE10A
SCHEMBL18160172 0.77 CCNB2 (0.53) CCNB2CDK1CCNB1CCNB3KMT2A
SCHEMBL8533456 0.77 PTGS2 (0.52) KMT2AMAPTLMNAMEN1PTGS2
SCHEMBL9607489 0.77 HTT (0.48) KMT2ALMNAMEN1PTGS2KDM4E
SCHEMBL8534472 0.76 KDM4E (0.50) KMT2AMAPTLMNAMEN1PTGS2
SCHEMBL8020349 0.76 PDE10A (0.64) KMT2ALMNAMEN1PTGS2KDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012069856-A1 ANTIMALARIAL COMPOUNDS LIVERPOOL SCHOOL OF TROPICAL MEDICINE (GB) 2012-05-31 WO claimed
WO-2012069856-A1 ANTIMALARIAL COMPOUNDS LIVERPOOL SCHOOL OF TROPICAL MEDICINE (GB) 2012-05-31 WO disclosed